Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hug_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASN 1.A O no hydrogen 3.385 N/A LYS 6.A N MET 2.A O no hydrogen 2.963 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 3.541 N/A GLU 7.A N SER 3.A O no hydrogen 2.981 N/A THR 8.A N PHE 4.A O no hydrogen 3.228 N/A THR 8.A OG1 PHE 4.A O no hydrogen 3.343 N/A THR 8.A OG1 VAL 5.A O no hydrogen 2.866 N/A VAL 9.A N VAL 5.A O no hydrogen 3.086 N/A ASP 10.A N LYS 6.A O no hydrogen 3.182 N/A LYS 11.A N GLU 7.A O no hydrogen 3.050 N/A LYS 11.A N THR 8.A O no hydrogen 3.225 N/A LEU 12.A N THR 8.A O no hydrogen 3.134 N/A TYR 16.A N LEU 13.A O no hydrogen 3.241 N/A ARG 19.A N ASP 17.A OD1 no hydrogen 3.218 N/A ARG 19.A NE ASP 17.A OD1 no hydrogen 3.266 N/A ARG 21.A NH1 PRO 27.A O no hydrogen 2.867 N/A ARG 21.A NH2 PHE 24.A O no hydrogen 3.181 N/A GLY 26.A N ASP 23.A O no hydrogen 3.283 N/A VAL 29.A N ASP 156.A O no hydrogen 2.979 N/A CYS 30.A SG PRO 28.A O no hydrogen 4.044 N/A CYS 30.A SG GLU 158.A OE1 no hydrogen 3.314 N/A VAL 31.A N GLU 158.A O no hydrogen 2.764 N/A GLY 32.A N TYR 59.A O no hydrogen 2.788 N/A MET 33.A N TYR 160.A O no hydrogen 2.923 N/A ASN 34.A N GLN 57.A O no hydrogen 2.995 N/A ASP 36.A N TYR 55.A O no hydrogen 2.909 N/A ILE 37.A N THR 169.A O no hydrogen 3.353 N/A ALA 38.A N THR 53.A O no hydrogen 3.012 N/A SER 39.A N THR 53.A O no hydrogen 3.397 N/A SER 39.A OG ASP 41.A OD1 no hydrogen 2.868 N/A ASP 41.A N THR 51.A O no hydrogen 2.901 N/A SER 44.A N ASP 49.A O no hydrogen 3.050 N/A SER 44.A OG ASN 47.A OD1 no hydrogen 3.098 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.865 N/A ASN 47.A N SER 44.A OG no hydrogen 3.041 N/A ASP 49.A N SER 44.A O no hydrogen 3.358 N/A TYR 50.A N ALA 127.A O no hydrogen 2.984 N/A TYR 50.A OH THR 144.A O no hydrogen 2.509 N/A THR 51.A N MET 42.A O no hydrogen 2.961 N/A LEU 52.A N THR 125.A O no hydrogen 2.691 N/A THR 53.A N SER 39.A O no hydrogen 3.127 N/A THR 53.A OG1 ASP 41.A OD2 no hydrogen 3.313 N/A THR 53.A OG1 THR 124.A OG1 no hydrogen 3.042 N/A MET 54.A N ILE 123.A O no hydrogen 2.962 N/A TYR 55.A N ASP 36.A O no hydrogen 2.446 N/A PHE 56.A N LEU 121.A O no hydrogen 2.921 N/A GLN 57.A N ASN 34.A O no hydrogen 2.855 N/A GLN 58.A N TYR 119.A O no hydrogen 3.203 N/A TYR 59.A N GLY 32.A O no hydrogen 2.873 N/A TRP 60.A N VAL 117.A O no hydrogen 3.384 N/A ASP 62.A N GLY 115.A O no hydrogen 2.748 N/A ARG 64.A NE ASP 62.A OD1 no hydrogen 3.418 N/A ARG 64.A NH1 ASP 17.A O no hydrogen 2.694 N/A ARG 64.A NH2 ASP 17.A O no hydrogen 3.483 N/A ARG 64.A NH2 LEU 20.A O no hydrogen 3.042 N/A ARG 64.A NH2 ASP 62.A OD1 no hydrogen 3.509 N/A LEU 65.A N ASP 62.A O no hydrogen 3.096 N/A TYR 67.A OH LEU 72.A O no hydrogen 2.437 N/A TYR 67.A OH LEU 111.A O no hydrogen 3.237 N/A LEU 74.A N TYR 67.A OH no hydrogen 3.267 N/A LEU 76.A N ILE 109.A O no hydrogen 2.806 N/A ASN 78.A ND2 LYS 105.A O no hydrogen 2.385 N/A ARG 79.A N ASP 77.A OD2 no hydrogen 3.298 N/A VAL 80.A N ASP 77.A O no hydrogen 3.206 N/A ALA 81.A N ASN 78.A O no hydrogen 3.368 N/A GLN 83.A N VAL 80.A O no hydrogen 2.908 N/A TRP 85.A N TYR 16.A OH no hydrogen 3.361 N/A TYR 90.A N GLU 148.A O no hydrogen 2.901 N/A LEU 92.A N GLU 146.A O no hydrogen 3.181 N/A ASP 94.A N PHE 91.A O no hydrogen 3.372 N/A LYS 95.A N THR 126.A O no hydrogen 2.827 N/A LYS 95.A NZ ASN 47.A O no hydrogen 2.701 N/A LYS 95.A NZ ASP 49.A OD2 no hydrogen 3.336 N/A SER 97.A OG ASP 94.A OD1 no hydrogen 3.409 N/A SER 97.A OG ASP 94.A OD2 no hydrogen 2.413 N/A HIS 100.A N ARG 122.A O no hydrogen 3.412 N/A HIS 100.A NE2 THR 124.A OG1 no hydrogen 2.369 N/A ASN 106.A N HIS 100.A O no hydrogen 2.938 N/A ASN 106.A ND2 VAL 102.A O no hydrogen 3.636 N/A ARG 107.A N LYS 105.A O no hydrogen 2.706 N/A ARG 107.A NH1 ASP 82.A OD1 no hydrogen 3.028 N/A MET 108.A N GLY 120.A O no hydrogen 3.203 N/A ARG 110.A N LEU 118.A O no hydrogen 3.105 N/A ARG 110.A NE THR 75.A OG1 no hydrogen 3.406 N/A LEU 111.A N LEU 74.A O no hydrogen 2.798 N/A HIS 112.A N THR 116.A O no hydrogen 2.773 N/A HIS 112.A ND1 ASN 73.A OD1 no hydrogen 2.829 N/A GLY 115.A N HIS 112.A O no hydrogen 2.982 N/A THR 116.A N ASP 114.A OD1 no hydrogen 3.189 N/A THR 116.A OG1 ASP 114.A OD1 no hydrogen 3.237 N/A THR 116.A OG1 ASP 114.A OD2 no hydrogen 3.445 N/A VAL 117.A N TRP 60.A O no hydrogen 2.790 N/A LEU 118.A N ARG 110.A O no hydrogen 3.158 N/A TYR 119.A N GLN 58.A O no hydrogen 3.154 N/A LEU 121.A N PHE 56.A O no hydrogen 2.582 N/A ILE 123.A N MET 54.A O no hydrogen 2.977 N/A THR 124.A N PHE 98.A O no hydrogen 3.345 N/A THR 124.A OG1 THR 53.A OG1 no hydrogen 3.042 N/A THR 124.A OG1 HIS 100.A NE2 no hydrogen 2.369 N/A THR 125.A N LEU 52.A O no hydrogen 2.736 N/A THR 125.A OG1 ASP 94.A OD1 no hydrogen 3.175 N/A THR 126.A N LYS 96.A O no hydrogen 3.015 N/A THR 126.A OG1 LYS 96.A O no hydrogen 3.233 N/A ALA 127.A N TYR 50.A O no hydrogen 2.883 N/A ALA 128.A N ASN 93.A O no hydrogen 2.754 N/A CYS 129.A N MET 48.A O no hydrogen 3.150 N/A ASP 132.A N GLN 141.A OE1 no hydrogen 2.910 N/A LEU 133.A N TYR 270.A OH no hydrogen 2.972 N/A ARG 134.A NE ASP 132.A OD1 no hydrogen 2.928 N/A ARG 134.A NH2 ASP 132.A OD2 no hydrogen 3.030 N/A ARG 135.A NH1 TYR 334.A O no hydrogen 2.845 N/A TYR 136.A N LEU 133.A O no hydrogen 3.393 N/A LEU 138.A N ARG 135.A O no hydrogen 2.544 N/A GLN 141.A NE2 ASP 132.A O no hydrogen 2.605 N/A GLN 141.A NE2 ASP 139.A OD2 no hydrogen 3.007 N/A CYS 143.A N PHE 205.A O no hydrogen 2.920 N/A LEU 145.A N LEU 203.A O no hydrogen 2.542 N/A GLU 146.A N ASN 93.A OD1 no hydrogen 2.828 N/A ILE 147.A N LEU 201.A O no hydrogen 2.603 N/A GLU 148.A N TYR 90.A O no hydrogen 3.113 N/A SER 149.A OG ASP 88.A OD1 no hydrogen 3.153 N/A SER 149.A OG TYR 152.A O no hydrogen 3.459 N/A TYR 150.A N ASP 88.A O no hydrogen 3.042 N/A GLY 151.A N ASP 88.A OD2 no hydrogen 2.898 N/A THR 154.A N ALA 197.A O no hydrogen 2.585 N/A ASP 156.A N THR 153.A O no hydrogen 3.277 N/A ILE 157.A N THR 153.A O no hydrogen 3.096 N/A GLU 158.A N VAL 29.A O no hydrogen 2.857 N/A TYR 160.A N VAL 31.A O no hydrogen 3.238 N/A ARG 162.A N MET 33.A O no hydrogen 3.074 N/A THR 169.A N ILE 35.A O no hydrogen 3.171 N/A THR 169.A OG1 ASP 36.A OD1 no hydrogen 3.247 N/A ILE 174.A N VAL 171.A O no hydrogen 3.287 N/A VAL 182.A N ARG 206.A O no hydrogen 2.994 N/A ARG 185.A N SER 204.A O no hydrogen 3.126 N/A VAL 187.A N SER 202.A O no hydrogen 3.282 N/A ARG 189.A N ARG 200.A O no hydrogen 3.244 N/A VAL 191.A N TYR 198.A O no hydrogen 3.137 N/A PHE 193.A N GLY 196.A O no hydrogen 2.862 N/A THR 195.A OG1 TYR 198.A OH no hydrogen 3.104 N/A TYR 198.A N VAL 191.A O no hydrogen 3.071 N/A TYR 198.A OH THR 195.A OG1 no hydrogen 3.104 N/A ARG 200.A N ARG 189.A O no hydrogen 3.162 N/A ARG 200.A NE GLU 148.A OE1 no hydrogen 3.273 N/A ARG 200.A NH2 GLU 148.A OE1 no hydrogen 2.695 N/A ARG 200.A NH2 GLU 148.A OE2 no hydrogen 3.326 N/A LEU 201.A N ILE 147.A O no hydrogen 2.800 N/A SER 202.A N VAL 187.A O no hydrogen 3.174 N/A LEU 203.A N LEU 145.A O no hydrogen 2.973 N/A SER 204.A N ARG 185.A O no hydrogen 3.348 N/A PHE 205.A N CYS 143.A O no hydrogen 2.922 N/A ARG 206.A N GLU 183.A O no hydrogen 3.210 N/A ARG 206.A NH1 GLU 183.A OE2 no hydrogen 2.483 N/A LEU 207.A N GLN 141.A O no hydrogen 2.739 N/A LYS 208.A N SER 180.A O no hydrogen 2.871 N/A ARG 209.A N ASP 139.A O no hydrogen 3.498 N/A ARG 209.A NE ASP 139.A OD1 no hydrogen 3.535 N/A ARG 209.A NH1 GLU 45.A OE2 no hydrogen 2.993 N/A ARG 209.A NH2 GLU 45.A OE2 no hydrogen 2.764 N/A ASN 210.A N GLN 178.A O no hydrogen 3.018 N/A ILE 215.A N ILE 211.A O no hydrogen 3.114 N/A GLN 217.A N TYR 213.A O no hydrogen 3.087 N/A THR 218.A N PHE 214.A O no hydrogen 2.985 N/A THR 218.A OG1 PHE 214.A O no hydrogen 2.325 N/A TYR 219.A N PHE 214.A O no hydrogen 3.021 N/A TYR 219.A OH TYR 331.A OH no hydrogen 2.863 N/A MET 220.A N ILE 215.A O no hydrogen 2.843 N/A ILE 223.A N TYR 219.A O no hydrogen 2.894 N/A LEU 224.A N MET 220.A O no hydrogen 3.196 N/A ILE 225.A N PRO 221.A O no hydrogen 2.936 N/A THR 226.A N SER 222.A O no hydrogen 3.424 N/A THR 226.A OG1 SER 222.A O no hydrogen 2.669 N/A ILE 227.A N ILE 223.A O no hydrogen 2.959 N/A LEU 228.A N LEU 224.A O no hydrogen 3.151 N/A SER 229.A N ILE 225.A O no hydrogen 3.128 N/A SER 229.A N THR 226.A O no hydrogen 3.247 N/A SER 229.A OG THR 226.A O no hydrogen 2.334 N/A TRP 230.A N ILE 227.A O no hydrogen 3.090 N/A VAL 231.A N LEU 228.A O no hydrogen 3.331 N/A SER 232.A OG SER 229.A O no hydrogen 3.162 N/A PHE 233.A N TRP 230.A O no hydrogen 3.238 N/A TRP 234.A N VAL 231.A O no hydrogen 3.235 N/A ALA 239.A N ASN 236.A O no hydrogen 3.138 N/A SER 240.A N ASP 238.A O no hydrogen 2.737 N/A SER 240.A OG TYR 292.A OH no hydrogen 2.790 N/A ARG 243.A N ALA 239.A O no hydrogen 3.134 N/A ARG 243.A NE SER 232.A O no hydrogen 2.586 N/A ARG 243.A NH2 ASP 313.A OD1 no hydrogen 3.387 N/A VAL 244.A N SER 240.A O no hydrogen 3.253 N/A LEU 246.A N ALA 242.A O no hydrogen 2.966 N/A GLY 247.A N ARG 243.A O no hydrogen 3.271 N/A ILE 248.A N VAL 244.A O no hydrogen 2.768 N/A THR 249.A N ALA 245.A O no hydrogen 3.287 N/A THR 249.A OG1 ALA 245.A O no hydrogen 2.536 N/A THR 250.A N LEU 246.A O no hydrogen 3.075 N/A THR 250.A OG1 LEU 246.A O no hydrogen 2.308 N/A VAL 251.A N GLY 247.A O no hydrogen 3.012 N/A LEU 252.A N ILE 248.A O no hydrogen 3.176 N/A THR 253.A N THR 249.A O no hydrogen 2.835 N/A THR 253.A OG1 THR 249.A O no hydrogen 2.646 N/A MET 254.A N THR 250.A O no hydrogen 3.097 N/A THR 255.A N VAL 251.A O no hydrogen 3.157 N/A THR 255.A OG1 VAL 251.A O no hydrogen 2.532 N/A THR 256.A N LEU 252.A O no hydrogen 2.981 N/A THR 256.A OG1 LEU 252.A O no hydrogen 3.464 N/A THR 256.A OG1 THR 253.A O no hydrogen 2.878 N/A ILE 257.A N THR 253.A O no hydrogen 3.062 N/A ASN 258.A N MET 254.A O no hydrogen 3.099 N/A THR 259.A N THR 255.A O no hydrogen 2.907 N/A THR 259.A OG1 THR 255.A O no hydrogen 3.272 N/A THR 259.A OG1 THR 256.A O no hydrogen 3.254 N/A HIS 260.A N THR 256.A O no hydrogen 3.064 N/A LEU 261.A N ILE 257.A O no hydrogen 3.048 N/A ARG 262.A N ASN 258.A O no hydrogen 3.108 N/A GLU 263.A N THR 259.A O no hydrogen 3.258 N/A GLU 263.A N HIS 260.A O no hydrogen 3.096 N/A THR 264.A N HIS 260.A O no hydrogen 3.149 N/A THR 264.A OG1 HIS 260.A O no hydrogen 3.345 N/A LEU 265.A N LEU 261.A O no hydrogen 3.271 N/A LYS 267.A NZ ARG 262.A O no hydrogen 3.440 N/A TYR 270.A N ILE 268.A O no hydrogen 2.666 N/A LYS 272.A NZ ILE 268.A O no hydrogen 3.016 N/A LYS 272.A NZ TYR 270.A O no hydrogen 3.379 N/A LYS 272.A NZ ASP 275.A OD2 no hydrogen 3.022 N/A ILE 274.A N TYR 136.A O no hydrogen 3.028 N/A MET 276.A N LYS 272.A O no hydrogen 3.267 N/A TYR 277.A N ALA 273.A O no hydrogen 3.246 N/A TYR 277.A OH ASN 328.A OD1 no hydrogen 3.078 N/A LEU 278.A N ILE 274.A O no hydrogen 3.135 N/A MET 279.A N ASP 275.A O no hydrogen 3.048 N/A GLY 280.A N MET 276.A O no hydrogen 2.987 N/A CYS 281.A N TYR 277.A O no hydrogen 2.822 N/A CYS 281.A SG SER 222.A OG no hydrogen 3.276 N/A CYS 281.A SG TYR 277.A O no hydrogen 3.477 N/A PHE 282.A N LEU 278.A O no hydrogen 3.117 N/A VAL 283.A N MET 279.A O no hydrogen 3.214 N/A VAL 283.A N GLY 280.A O no hydrogen 3.229 N/A PHE 284.A N GLY 280.A O no hydrogen 3.470 N/A VAL 285.A N CYS 281.A O no hydrogen 3.303 N/A PHE 286.A N PHE 282.A O no hydrogen 2.943 N/A LEU 287.A N VAL 283.A O no hydrogen 2.687 N/A ALA 288.A N PHE 284.A O no hydrogen 3.096 N/A LEU 289.A N PHE 286.A O no hydrogen 3.334 N/A LEU 290.A N PHE 286.A O no hydrogen 3.258 N/A GLU 291.A N LEU 287.A O no hydrogen 3.253 N/A TYR 292.A OH TYR 237.A O no hydrogen 3.071 N/A TYR 292.A OH SER 240.A OG no hydrogen 2.790 N/A PHE 294.A N LEU 290.A O no hydrogen 3.050 N/A VAL 295.A N GLU 291.A O no hydrogen 2.932 N/A ASN 296.A N TYR 292.A O no hydrogen 2.591 N/A TYR 297.A N ALA 293.A O no hydrogen 2.963 N/A ILE 298.A N PHE 294.A O no hydrogen 3.290 N/A ILE 298.A N VAL 295.A O no hydrogen 3.153 N/A PHE 299.A N VAL 295.A O no hydrogen 3.055 N/A PHE 300.A N ASN 296.A O no hydrogen 3.227 N/A GLY 301.A N TYR 297.A O no hydrogen 3.040 N/A ARG 302.A N TYR 297.A O no hydrogen 2.895 N/A ARG 306.A N GLY 303.A O no hydrogen 3.082 N/A ILE 312.A N ASP 308.A O no hydrogen 3.376 N/A ASP 313.A N VAL 309.A O no hydrogen 3.150 N/A ARG 314.A N ASN 310.A O no hydrogen 2.974 N/A TRP 315.A N ALA 311.A O no hydrogen 3.135 N/A SER 316.A N ILE 312.A O no hydrogen 3.070 N/A SER 316.A OG ILE 312.A O no hydrogen 3.000 N/A ARG 317.A N ASP 313.A O no hydrogen 3.230 N/A ARG 317.A NE PHE 233.A O no hydrogen 3.258 N/A ARG 317.A NH2 PHE 233.A O no hydrogen 2.793 N/A ILE 318.A N TRP 315.A O no hydrogen 3.305 N/A VAL 319.A N TRP 315.A O no hydrogen 2.934 N/A PHE 320.A N SER 316.A O no hydrogen 3.150 N/A THR 323.A N VAL 319.A O no hydrogen 2.577 N/A THR 323.A OG1 VAL 319.A O no hydrogen 2.955 N/A PHE 324.A N PHE 320.A O no hydrogen 3.144 N/A SER 325.A N PRO 321.A O no hydrogen 3.119 N/A LEU 326.A N PHE 322.A O no hydrogen 2.922 N/A PHE 327.A N THR 323.A O no hydrogen 2.761 N/A ASN 328.A N PHE 324.A O no hydrogen 3.099 N/A LEU 329.A N SER 325.A O no hydrogen 3.076 N/A VAL 330.A N LEU 326.A O no hydrogen 2.987 N/A TYR 331.A N PHE 327.A O no hydrogen 2.958 N/A TYR 331.A OH TYR 219.A OH no hydrogen 2.863 N/A TYR 331.A OH ALA 273.A O no hydrogen 2.593 N/A TRP 332.A N ASN 328.A O no hydrogen 2.837 N/A TYR 334.A N VAL 330.A O no hydrogen 3.124 N/A TYR 335.A N TYR 331.A O no hydrogen 3.272 N/A